BAS 02234869
TL;DR: BAS 02234869 (CAS 307541-71-5) is a chemical compound with molecular formula C22H19N3O5S and molecular weight 437.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(3-ethoxy-4-hydroxyphenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: BAS 02234869, BIM-0003022.P001, (4E)-5-(3-ethoxy-4-hydroxyphenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione, 5-(3-ethoxy-4-hydroxyphenyl)-3-hydroxy-4-(4-methylbenzoyl)-1-(1,3,4-thiadiazol-2-yl)-1,5-dihydro-2H-pyrrol-2-one, 5-(3-ethoxy-4-hydroxyphenyl)-3-hydroxy-4-(4-methylbenzoyl)-1-(1,3,4-thiadiazol-2-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C22H19N3O5S |
|---|---|
| Molecular Weight | 437.10 g/mol |
| LogP | 3.57712 |
| Topological Polar Surface Area | 112.85 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 437.10455 |
| Heavy Atoms | 31 |
| Complexity | 1172.3668 |
Chemical Identifiers
| CAS Number | 307541-71-5 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)C2/C(=C(/C3=CC=C(C=C3)C)\O)/C(=O)C(=O)N2C4=NN=CS4)O |
Product Overview
BAS 02234869 (CAS 307541-71-5), with molecular formula C22H19N3O5S and molecular weight 437.10 g/mol. IUPAC: (4E)-5-(3-ethoxy-4-hydroxyphenyl)-4-[hydroxy-(4-methylphenyl)methylidene]-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 02234869
Property Insights of BAS 02234869
The XLogP value of 3.57712 indicates that BAS 02234869 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.85 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02234869. Following Lipinski's Rule of Five, BAS 02234869 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 02234869?
The CAS number of BAS 02234869 is 307541-71-5.
What is the molecular formula of BAS 02234869?
The molecular formula of BAS 02234869 is C22H19N3O5S.
What is the molecular weight of BAS 02234869?
The molecular weight of BAS 02234869 is 437.10 g/mol.
Where can I buy BAS 02234869?
You can request a quote for BAS 02234869 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02234869?
Yes, KEHONG BIO provides custom synthesis services for BAS 02234869 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.